Monomers

Methyl acrylate

Identifiers

IUPAC name
methyl prop-2-enoate
InchI
InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3
InchI Key
BAPJBEWLBFYGME-UHFFFAOYSA-N
SMILES
COC(=O)C=C
Canonical SMILES
COC(=O)C=C
Isomeric SMILES
COC(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
26.3
MolLogP
0.3454
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
   -1.8998    0.7775   -0.6671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6405    0.5207   -0.0294 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1142   -0.5963   -0.3595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3314   -1.3712   -1.2255 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4112   -0.8391    0.3133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8476    0.0008    1.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7178    0.5606   -1.7483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1591    1.8293   -0.5216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6683    0.1369   -0.2209 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0092   -1.6990    0.0703 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2504    0.8603    1.4645 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7843   -0.1805    1.7028 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  1  7  1  0
  1  8  1  0
  1  9  1  0
  5 10  1  0
  6 11  1  0
  6 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers